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We have carried out density-functional theory (DFT) calculations to study the magnetic stability of both ferromagnetic (FM) and anti-ferromagnetic (AFM) states in monolayer 1T-CrTe2. Our results show that the AFM order is lower in energy…

材料科学 · 物理学 2023-10-31 Ahmed Elrashidy , Jia-An Yan

BaFe$_2$As$_2$ with transition-metal doping exhibits a variety of rich phenomenon from coupling of structure, magnetism, and superconductivity. Using density functional theory, we systematically compare the Fermi surfaces (FS), formation…

计算物理 · 物理学 2014-05-28 Suffian Khan , Aftab Alam , Duane Johnson

Very recently, as an important step in the development of layered Fe-free pnictide-oxide superconductors, the new phase BaTi2Bi2O was discovered which has the highest TC (about 4.6 K) among all related non-doped systems. In this Letter, we…

超导电性 · 物理学 2015-06-12 D. V. Suetin , A. L. Ivanovskii

From the first-principles calculations, we have studied the electronic and magnetic structures of compound Na$_2$Ti$_2$Pn$_2$O (Pn = As or Sb). We find that in the ground state Na$_2$Ti$_2$As$_2$O is a blocked checkerboard antiferromagnetic…

超导电性 · 物理学 2013-08-12 Xun-Wang Yan , Zhong-Yi Lu

The properties and mechanism of the magnetic phase transition of the perovskite-type Ti oxides, which is driven by the Ti-O-Ti bond angle distortion, are studied theoretically by using the effective spin and pseudospin Hamiltonian with…

强关联电子 · 物理学 2007-05-23 Masahito Mochizuki , Masatoshi Imada

Ferromagnetic insulators (FM-Is) are the materials of interest for new generation quantum electronic applications. Here, we have investigated the physical observables depicting FM-I ground states in epitaxial Sm$ _{2} $NiMnO$ _{6} $ (SNMO)…

材料科学 · 物理学 2022-04-20 Supriyo Majumder , Malvika Tripathi , I Píš , S Nappini , P Rajput , S N Jha , R J Choudhary , D M Phase

We report quantum oscillation measurements that enable the direct observation of the Fermi surface of the low temperature ground state of \ba122. From these measurements we characterize the low energy excitations, revealing that the Fermi…

The paper discusses the magnetic state of zeta phase of iron nitride viz. $\zeta$-Fe$_2$N on the basis of spin polarized first principles electronic structure calculations together with a review of already published data. Results of our…

材料科学 · 物理学 2017-06-20 K. Sandeep Rao , H. G. Salunke

In double perovskite oxides (A$_2$BB$^\prime$O$_6$), magnetism often arises from diluted magnetic lattices, created by combining a perovskite structure with localized 3$d$ magnetic elements (B) alongside another perovskite lattice…

强关联电子 · 物理学 2024-08-20 Sromona Nandi , Subhadip Pradhan , Ashis K. Nandy , Rudra Sekhar Manna

The electronic nematic state without magnetization emerges in various strongly correlated metals such as Fe-based and cuprate superconductors. To understand this universal phenomenon, we focus on the nematic state in Ti-oxypnictide…

强关联电子 · 物理学 2016-06-15 Hironori Nakaoka , Youichi Yamakawa , Hiroshi Kontani

The antiferromagnetic (AFM) state has been investigated in the three heavy-fermion compounds URu2Si2, UPd2Al3, and UNi2Al3 by measuring dV/dI(V) curves of point contacts at different temperatures (1.5-20 K) and magnetic fields (0-28 T). The…

强关联电子 · 物理学 2009-11-07 Yu. G. Naidyuk , O. E. Kvitnitskaya , A. G. M. Jansen , C. Geibel , A. A. Menovsky , P. Wyder

We report electronic structure calculations for BaTi$_2$Sb$_2$O and discuss the results in relation to the observed superconductivity of this material when hole doped with Na. The Fermi surface shows several sheets. These include a nested…

超导电性 · 物理学 2012-12-10 D. J. Singh

The large quantum oscillations observed in the thermoelectric power in the antiferromagnetic (AF) state of the heavy-fermion compound CeRh2Si2 disappear suddenly when entering in the polarized paramagnetic (PPM) state at Hc=26.5 T,…

Resonant activation of a synthetic antiferromagnet (SAF) is known to result in a dynamic running state, where the SAF's symmetric spin-flop pair continuously rotates between the two antiparallel ground states of the system, with the two…

介观与纳米尺度物理 · 物理学 2013-11-27 B. C. Koop , Yu. I. Dzhezherya , K. Demishev , V. Iurchuk , D. C. Worledge , V. Korenivski

We report evidence that the experimentally found antiferromagnetic structure as well as the semiconducting ground state of BaMn$_2$As$_2$ are caused by optimally-localized Wannier states of special symmetry existing at the Fermi level of…

强关联电子 · 物理学 2016-09-29 Ekkehard Krüger

Inelastic neutron scattering measurements of paramagnetic SrCo$_{2}$As$_{2}$ at T=5 K reveal antiferromagnetic (AFM) spin fluctuations that are peaked at a wavevector of $\textbf{Q}_{\mathrm{AFM}}=(1/2,1/2,1)$ and possess a large energy…

Altermagnet (AM) is a new proposed magnetic state with collinear antiferromagnetic ground state but presents some transport properties that were only believed to exist in ferromagnets or non-collinear antiferromagnets. To have a…

材料科学 · 物理学 2024-09-25 Yingliang Huang , Junwen Lai , Jie Zhan , Tianye Yu , Rong Chen , Peitao Liu , Xing-Qiu Chen , Yan Sun

Properties and mechanism of the magnetic phase transition of the perovskite-type Ti oxides, which is driven by the Ti-O-Ti bond angle distortion, are studied theoretically by using the effective spin and pseudo-spin Hamiltonian with strong…

强关联电子 · 物理学 2009-09-25 Masahito Mochizuki , Masatoshi Imada

We examine electronic states of antiferromagnetic phase in iron pnictides by mean-field calculations of the optical conductivity. We find that a five-band model exhibiting a small magnetic moment, inconsistent with the first-principles…

超导电性 · 物理学 2009-12-14 E. Kaneshita , T. Morinari , T. Tohyama

We report on the quenching of single Ni adatom moments on Te-terminated Bi2Te2Se and Bi2Te3 topological insulator surfaces. The effect becomes manifested as a missing X-ray magnetic circular dichroism for resonant L3,2 transitions into…

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